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DFT+U
--- ACBN0IntersiteCutoff
--- ACBN0IntersiteInteraction
--- ACBN0RotationallyInvariant
--- ACBN0Screening
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ACBN0RotationallyInvariant
ACBN0RotationallyInvariant
Section Hamiltonian::DFT+U
Type logical
If set to yes, Octopus will use for U and J a formula which is rotationally invariant.
This is different from the original formula for U and J.
This is activated by default, except in the case of spinors, as this is not yet implemented in this case.
Source information
hamiltonian/lda_u.F90 : 315
call parse_variable ( namespace , 'ACBN0RotationallyInvariant' , st % d % ispin /= SPINORS , this % rot_inv )